BindingDB logo
myBDB logout

BDBM50262508 3-(4-(3-(2-chloro-4-fluorophenyl)-1,2,4-oxadiazol-5-yl)piperidin-1-yl)quinoline::CHEMBL478203

SMILES: Fc1ccc(-c2noc(n2)C2CCN(CC2)c2cnc3ccccc3c2)c(Cl)c1

InChI Key: InChIKey=YKKVBHCDPMQIEG-UHFFFAOYSA-N

Data: 4 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50262508   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50262508
PNG
(3-(4-(3-(2-chloro-4-fluorophenyl)-1,2,4-oxadiazol-...)
Show SMILES Fc1ccc(-c2noc(n2)C2CCN(CC2)c2cnc3ccccc3c2)c(Cl)c1
Show InChI InChI=1S/C22H18ClFN4O/c23-19-12-16(24)5-6-18(19)21-26-22(29-27-21)14-7-9-28(10-8-14)17-11-15-3-1-2-4-20(15)25-13-17/h1-6,11-14H,7-10H2
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 3.03E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor expressed in insect Sf9 cells assessed as effect on Eu-GTP binding


Bioorg Med Chem Lett 18: 4267-74 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.096
BindingDB Entry DOI: 10.7270/Q21C1WQ8
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50262508
PNG
(3-(4-(3-(2-chloro-4-fluorophenyl)-1,2,4-oxadiazol-...)
Show SMILES Fc1ccc(-c2noc(n2)C2CCN(CC2)c2cnc3ccccc3c2)c(Cl)c1
Show InChI InChI=1S/C22H18ClFN4O/c23-19-12-16(24)5-6-18(19)21-26-22(29-27-21)14-7-9-28(10-8-14)17-11-15-3-1-2-4-20(15)25-13-17/h1-6,11-14H,7-10H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 89n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in insect Sf9 cells assessed as effect on Eu-GTP binding


Bioorg Med Chem Lett 18: 4267-74 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.096
BindingDB Entry DOI: 10.7270/Q21C1WQ8
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50262508
PNG
(3-(4-(3-(2-chloro-4-fluorophenyl)-1,2,4-oxadiazol-...)
Show SMILES Fc1ccc(-c2noc(n2)C2CCN(CC2)c2cnc3ccccc3c2)c(Cl)c1
Show InChI InChI=1S/C22H18ClFN4O/c23-19-12-16(24)5-6-18(19)21-26-22(29-27-21)14-7-9-28(10-8-14)17-11-15-3-1-2-4-20(15)25-13-17/h1-6,11-14H,7-10H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 17n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor assessed as inhibition of forskolin-induced increase in intracellular cAMP


Bioorg Med Chem Lett 18: 4267-74 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.096
BindingDB Entry DOI: 10.7270/Q21C1WQ8
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50262508
PNG
(3-(4-(3-(2-chloro-4-fluorophenyl)-1,2,4-oxadiazol-...)
Show SMILES Fc1ccc(-c2noc(n2)C2CCN(CC2)c2cnc3ccccc3c2)c(Cl)c1
Show InChI InChI=1S/C22H18ClFN4O/c23-19-12-16(24)5-6-18(19)21-26-22(29-27-21)14-7-9-28(10-8-14)17-11-15-3-1-2-4-20(15)25-13-17/h1-6,11-14H,7-10H2
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>1.00E+3n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor assessed as inhibition of forskolin-induced increase in intracellular cAMP


Bioorg Med Chem Lett 18: 4267-74 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.096
BindingDB Entry DOI: 10.7270/Q21C1WQ8
More data for this
Ligand-Target Pair